%chk=000083189.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083189

0 1
 O    1.765800       2.769800      0.1384000    
 O  -0.6074000      -2.725500     -0.2813000    
 O    4.200100      -1.273600      0.1080000    
 N  -0.7675000       1.318000     -0.1715000    
 C   0.5009000      0.6994000     -9.1100000E-02
 C   -1.976600      0.5996000     -3.0900000E-02
 C   0.5887000     -0.7065000     -9.7599998E-02
 C   -1.951400     -0.8087000     -3.6200002E-02
 C  -0.6534000      -1.508600     -0.1555000    
 C    1.710700       1.410000      1.3300000E-02
 C    1.822400      -1.370400     -3.8800001E-02
 C  -0.8306000       2.770200     -0.3594000    
 C   -3.233100       1.211200      0.1334000    
 C   -3.123500      -1.569300      8.0100000E-02
 C    3.000000     -0.6363000      4.4500001E-02
 C    2.944000      0.7519000      7.6300003E-02
 C   -4.405100      0.4564000      0.2545000    
 C   -4.350900     -0.9317000      0.2220000    
 C    5.366800     -0.4559000      0.1919000    
 H    1.875400      -2.456100     -4.8500001E-02
 H  -0.1083000       3.113300      -1.108800    
 H  -0.6844000       3.296900      0.5895000    
 H   -1.779300       3.107700     -0.7887000    
 H   -3.344900       2.289300      0.1984000    
 H   -3.096200      -2.655500      7.1000002E-02
 H    3.832600       1.368900      0.1626000    
 H   -5.360100      0.9588000      0.3806000    
 H   -5.261400      -1.515600      0.3171000    
 H    2.688900       3.066300      0.2060000    
 H    5.383300      0.1275000       1.118700    
 H    5.484100      0.1721000     -0.6979000    
 H    6.230300      -1.128400      0.2233000    


%chk=000083189-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083189

0 1
O 1.666593 2.866896 0.350251
O -0.560641 -2.810062 -0.204377
O 4.224296 -1.333307 0.000109
N -0.786128 1.375341 -0.111615
C 0.482194 0.749045 -0.034885
C -1.962755 0.611164 0.019545
C 0.586432 -0.684167 -0.085116
C -1.913320 -0.821621 0.026656
C -0.630966 -1.537163 -0.107403
C 1.710526 1.467760 0.134006
C 1.839026 -1.338771 -0.068024
C -0.937721 2.798437 -0.504608
C -3.237048 1.249864 0.129876
C -3.115944 -1.570219 0.140042
C 3.027839 -0.600952 0.015431
C 2.957105 0.812058 0.132770
C -4.408939 0.485823 0.246038
C -4.360032 -0.934824 0.248639
C 5.480217 -0.589172 0.095588
H 1.851687 -2.430967 -0.113767
H -0.000787 3.168772 -0.931360
H -1.193053 3.437755 0.359749
H -1.733771 2.876380 -1.265290
H -3.311896 2.339480 0.156995
H -3.019945 -2.661154 0.131892
H 3.867677 1.412259 0.249274
H -5.372125 0.999620 0.344134
H -5.280928 -1.519730 0.337144
H 2.569074 3.201859 0.578033
H 5.556876 -0.042830 1.056853
H 5.596374 0.120315 -0.747881
H 6.269984 -1.352688 0.044702


